Tert-butyl 3-[3-(aminomethyl)-1,2,4-oxadiazol-5-yl]-6-cyclohexylhexanoate → HCID 178450954, 화합물
반응식
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([CH2:7][CH:8]([CH2:9][CH2:10][CH2:11][CH:12]1[CH2:13][CH2:14][CH2:15][CH2:16][CH2:17]1)[c:18]1[n:19][c:20]([CH2:23][NH2:24])[n:21][o:22]1)=[O:25].[n:26]1[n:27][c:28]([S:31](=[O:32])(=[O:33])[Cl:34])[nH:29][cH:30]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([CH2:7][CH:8]([CH2:9][CH2:10][CH2:11][CH:12]1[CH2:13][CH2:14][CH2:15][CH2:16][CH2:17]1)[c:18]1[n:19][c:20]([CH2:23][NH:24][S:31]([c:28]2[n:27][n:26][cH:30][nH:29]2)(=[O:32])=[O:33])[n:21][o:22]1)=[O:25]참가 물질
3
출처 및 근거
- ORD 기록
- ord-f4520424fa9440839f2324c343e417af
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
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